4-(2-chlorophenyl)-5-methoxycarbonyl-2-methyl-6-[(E)-3-oxidanylidenebut-1-enyl]-1,4-dihydropyridine-3-carboxylic acid

Systemtic Name: 4-(2-chlorophenyl)-5-methoxycarbonyl-2-methyl-6-[(E)-3-oxidanylidenebut-1-enyl]-1,4-dihydropyridine-3-carboxylic acid Openeye Name: 4-(2-chlorophenyl)-5-methoxycarbonyl-2-methyl-6-[(E)-3-oxobut-1-enyl]-1,4-dihydropyridine-3-carboxylic acid CAS Name: 4-(2-chlorophenyl)-5-methoxycarbonyl-2-methyl-6-[(E)-3-oxobut-1-enyl]-1,4-dihydropyridine-3-carboxylic acid IUPAC Name: 4-(2-chlorophenyl)-5-methoxycarbonyl-2-methyl-6-[(E)-3-oxobut-1-enyl]-1,4-dihydropyridine-3-carboxylic acid Traditional Name: 5-carbomethoxy-4-(2-chlorophenyl)-6-[(E)-3-ketobut-1-enyl]-2-methyl-1,4-dihydropyridine-3-carboxylic acid Formula: C19H18ClNO5 MolecularWeight: 375.80292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C=CC(=O)C)C(=O)OC)C2=CC=CC=C2Cl)C(=O)O

Isomeric SMILES

CC1=C(C(C(=C(N1)/C=C/C(=O)C)C(=O)OC)C2=CC=CC=C2Cl)C(=O)O

InChI

InChI=1S/C19H18ClNO5/c1-10(22)8-9-14-17(19(25)26-3)16(12-6-4-5-7-13(12)20)15(18(23)24)11(2)21-14/h4-9,16,21H,1-3H3,(H,23,24)/b9-8+